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Details

Stereochemistry ACHIRAL
Molecular Formula C25H26N4O2S
Molecular Weight 446.565
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1Z-105

SMILES

CN1C2=C(C=CC=C2)C3=C1C(=O)N(C4=CC=CC=C4)C(SCC(=O)NC5CCCCC5)=N3

InChI

InChIKey=XIGDXFCDNWREER-UHFFFAOYSA-N
InChI=1S/C25H26N4O2S/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)32-16-21(30)26-17-10-4-2-5-11-17/h3,6-9,12-15,17H,2,4-5,10-11,16H2,1H3,(H,26,30)

HIDE SMILES / InChI

Molecular Formula C25H26N4O2S
Molecular Weight 446.565
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
YS8VEM6ZWU
Record Status Validated (UNII)
Record Version